2-(2,5-difluorophenyl)-3H-benzimidazol-5-ol

C13H8F2N2O — CID 81432602

IUPAC2-(2,5-difluorophenyl)-3H-benzimidazol-5-ol
SMILESOc1ccc2nc(-c3cc(F)ccc3F)[nH]c2c1
InChIInChI=1S/C13H8F2N2O/c14-7-1-3-10(15)9(5-7)13-16-11-4-2-8(18)6-12(11)17-13/h1-6,18H,(H,16,17)
InChIKeyYXIGAGKTLWGBMD-UHFFFAOYSA-N
MW246.22 g/mol
LogP3.21
Rot. Bonds1

About 2-(2,5-difluorophenyl)-3H-benzimidazol-5-ol

2-(2,5-difluorophenyl)-3H-benzimidazol-5-ol (PubChem CID 81432602) has the molecular formula C13H8F2N2O and a molecular weight of 246.22 g/mol. Its IUPAC name is 2-(2,5-difluorophenyl)-3H-benzimidazol-5-ol.

Molecular Properties

Compound Name2-(2,5-difluorophenyl)-3H-benzimidazol-5-ol
PubChem CID81432602
Molecular FormulaC13H8F2N2O
Molecular Weight246.22 g/mol
Exact Mass246.06
IUPAC Name2-(2,5-difluorophenyl)-3H-benzimidazol-5-ol
SMILESOc1ccc2nc(-c3cc(F)ccc3F)[nH]c2c1
InChIInChI=1S/C13H8F2N2O/c14-7-1-3-10(15)9(5-7)13-16-11-4-2-8(18)6-12(11)17-13/h1-6,18H,(H,16,17)
InChIKeyYXIGAGKTLWGBMD-UHFFFAOYSA-N
XLogP3.21
TPSA48.91 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.22
LogP ≤ 53.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2,5-difluorophenyl)-1H-benzimidazole
CID 43348986
2-(2,6-difluoro-3-methylphenyl)-3H-benzimidazol-5-ol
CID 82815117
4-(6-chloro-1H-benzimidazol-2-yl)benzene-1,3-diol
CID 136903703
2-(3-amino-4-fluorophenyl)-3H-benzimidazol-5-ol
CID 81432663
N-[2-(2,5-difluorophenyl)-3H-benzimidazol-5-yl]pyridine-4-carboxamide
CID 47066056
2-(2-fluoro-6-hydroxyphenyl)-3H-benzimidazol-5-ol
CID 136959757
3-fluoro-4-(6-methylsulfonyl-1H-benzimidazol-2-yl)phenol
CID 136751588
2-(2-bromophenyl)-3H-benzimidazol-5-ol
CID 81431199
2-(2-iodophenyl)-3H-benzimidazol-5-ol
CID 81431209
4-fluoro-2-(3H-imidazo[4,5-c]pyridin-2-yl)phenol
CID 137011269
2-(2,5-difluorophenyl)-4,6-difluoro-1H-benzimidazole
CID 81463378
4-(5,6-dichloro-1H-benzimidazol-2-yl)-3-fluorophenol
CID 136751628

Frequently Asked Questions

What is the IUPAC name of 2-(2,5-difluorophenyl)-3H-benzimidazol-5-ol?
The IUPAC name of 2-(2,5-difluorophenyl)-3H-benzimidazol-5-ol (CID 81432602) is 2-(2,5-difluorophenyl)-3H-benzimidazol-5-ol.
What is the SMILES notation for 2-(2,5-difluorophenyl)-3H-benzimidazol-5-ol?
The canonical SMILES for 2-(2,5-difluorophenyl)-3H-benzimidazol-5-ol is Oc1ccc2nc(-c3cc(F)ccc3F)[nH]c2c1.
What is the InChIKey of 2-(2,5-difluorophenyl)-3H-benzimidazol-5-ol?
The InChIKey is YXIGAGKTLWGBMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H8F2N2O/c14-7-1-3-10(15)9(5-7)13-16-11-4-2-8(18)6-12(11)17-13/h1-6,18H,(H,16,17).
What are the key properties of 2-(2,5-difluorophenyl)-3H-benzimidazol-5-ol?
2-(2,5-difluorophenyl)-3H-benzimidazol-5-ol has a molecular weight of 246.22 g/mol, XLogP of 3.21, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-difluorophenyl)-3H-benzimidazol-5-ol is sourced from PubChem (CID 81432602), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).